| Properties | Image |
MNX_ID | MNXM527742 |
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reference | chebi:90426 |
formula | C13H14N2OS |
global charge | 0 |
mol weight | 246.335 |
InChIKey | NCMHLYITDACZJV-LBPRGKRZSA-N |
InChI | InChI=1S/C13H14N2OS/c14-12(8-17)13(16)15-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12,17H,8,14H2,(H,15,16)/t12-/m0/s1 |
SMILES | N[C@@H](CS)C(=O)NC1=CC=C2C=CC=CC2=C1 |
MNX internals
InChI (mnx) | InChI=1/C13H14N2OS/c14-12(8-17)13(16)15-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12,17H,8,14H2,(H,15,16)/t12-/m0/s1 |
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SMILES (mnx) | [CH:1]1=[CH:2][CH:4]=[C:10]2[CH:7]=[C:11]([N:15]=[C:13]([C@H:12]([CH2:8][SH:17])[NH2:14])[OH:16])[CH:6]=[CH:5][C:9]2=[CH:3]1 |
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